NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3411 8.3049 118.1875 54.2243 33.2264 174.7790 2 K 4.2422 7.9500 119.4537 54.5782 33.9477 173.7429 3 T 4.6387 9.0775 122.2163 60.9966 71.9095 172.5611 4 P 4.4759 0.0000 0.0000 65.3069 32.6261 176.8909 5 L 4.5481 7.9003 118.5299 55.5115 42.1661 177.0955 6 V 4.8432 9.1830 121.7987 61.7575 35.7865 173.8825 7 T 4.6270 8.7583 115.2851 61.2536 70.0402 175.7507 8 R 4.0083 8.8666 123.7850 59.4924 29.7402 178.4739 9 E 4.2464 8.4312 117.1751 59.8525 29.6619 179.2520 10 G 3.9675 8.0807 107.6168 47.0781 0.0000 174.9462 11 Y 3.7566 8.0293 121.2096 60.8027 38.8516 177.4379 12 E 4.0670 8.1614 119.3024 59.7644 29.5595 179.7468 13 K 3.9492 7.8410 116.7865 59.5529 32.2443 179.0584 14 L 3.9700 7.8029 118.6228 58.1099 41.5656 180.0648 15 K 3.9905 8.2367 117.9260 59.5018 32.0837 178.9710 16 Q 4.0281 8.3262 120.1367 59.5109 28.8163 178.1905 17 E 3.9661 8.8892 119.6393 59.5556 29.5958 178.9120 18 L 3.7158 7.9459 119.6644 58.5082 41.9637 179.1882 19 N 4.4494 8.2003 116.2979 56.6722 38.5717 176.8440 20 Y 4.0061 8.6474 121.1412 60.4513 38.7394 178.2039 21 L 4.1283 9.0414 121.0046 57.5831 41.6769 178.9589 22 W 4.3349 8.2615 126.5086 59.1202 30.8266 177.1648 23 R 4.0975 8.2525 116.8444 56.2926 30.1103 176.4136 24 E 4.3080 7.9020 117.3774 57.2572 31.2240 176.9742 25 E 4.5582 8.5369 117.9482 58.1130 30.1495 178.2872 26 R 3.8930 8.1952 119.1498 59.0667 30.1002 176.7059 27 P 4.2001 0.0000 0.0000 65.5396 31.2530 178.1987 28 E 3.9519 7.5542 117.6995 59.4732 29.3793 179.5359 29 V 3.6532 8.0964 118.4156 66.4156 31.5612 178.0966 30 T 3.9028 8.0468 109.4694 64.8048 67.8930 176.0693 31 K 3.9851 7.9862 121.8874 59.0617 32.1397 178.8177 32 K 4.0688 7.9316 120.0679 59.7201 32.1483 178.8847 33 V 3.7923 7.6896 118.1374 66.6816 31.3138 177.7567 34 T 3.9093 7.8456 115.7492 66.3803 68.3378 176.2734 35 W 4.0557 8.5210 130.6024 59.6796 30.6472 177.7941 36 A 4.1466 8.7100 121.1870 55.3719 17.5729 179.5586 37 A 3.7047 7.6309 118.0039 55.2671 18.8229 179.5173 38 S 4.0535 7.7104 112.4439 61.7943 62.5135 176.8427 39 L 4.3729 8.7168 122.0452 57.3124 41.8687 177.6121 40 G 3.9419 7.4204 104.1192 45.7437 0.0000 171.3377 41 D 4.3839 8.0358 119.2855 53.6743 39.8738 177.4717 42 R 3.7201 8.5322 121.9670 59.6915 30.4697 178.2885 43 S 4.3208 8.1346 110.6695 61.2337 62.6529 175.0566 44 E 4.0001 8.2012 116.4322 58.8973 29.3368 176.4155 45 N 4.5172 7.9104 117.9504 52.9415 39.0734 175.2245 46 A 4.0950 8.6338 128.2599 54.6613 18.8312 178.5565 47 D 4.5338 8.5559 117.6955 57.2481 40.8791 178.2531 48 Y 4.2007 8.3484 119.9197 60.6540 38.8680 177.8596 49 Q 3.7084 7.8404 118.6767 58.8734 28.9566 177.6966 50 Y 4.0517 8.3719 120.9279 61.0412 38.9806 178.1415 51 N 4.2404 8.3035 117.2043 55.9047 38.5743 177.3982 52 K 3.7810 7.4946 121.1273 59.0455 32.1087 178.7701 53 K 3.7696 7.7662 119.9003 59.6126 32.2300 178.7175 54 R 3.9748 7.5360 120.1494 58.6636 29.7648 178.0739 55 L 4.1436 7.6940 119.5912 57.7147 41.9348 179.0655 56 R 3.9230 7.9114 118.3099 59.1455 30.0957 178.8238 57 E 3.9522 8.9580 119.2819 59.2537 29.4372 179.3704 58 I 3.6769 8.0380 120.2098 64.6998 37.4392 178.3647 59 D 4.5314 8.2853 119.1561 56.8447 40.5178 179.2392 60 R 3.9067 7.6252 119.3511 59.3863 30.1837 178.9211 61 R 3.9562 8.0245 118.4159 59.3179 30.1323 178.5408 62 V 3.6524 7.8431 118.3138 65.8996 31.3309 178.0369 63 R 3.8574 7.8631 117.9025 59.5525 29.9721 177.6728 64 Y 3.9807 8.0410 119.2288 60.6699 38.8090 177.5112 65 L 3.9669 8.6805 121.3966 58.7967 41.6597 178.8100 66 T 3.8554 7.7427 115.1720 66.8061 68.5475 176.5685 67 K 3.7843 7.7937 120.0771 60.1877 32.6566 179.0692 68 C 4.0500 8.1003 117.8675 62.1656 27.6506 175.6884 69 M 3.9534 7.8320 119.6429 58.7845 31.9080 177.8069 70 E 4.1697 7.5897 117.1446 58.8641 29.8023 178.1789 71 N 4.7025 7.8496 114.1830 52.9430 39.4226 175.5501 72 L 4.2913 7.7023 121.5506 54.9247 42.4644 176.7257 73 K 4.5621 9.1750 123.9338 55.0967 33.9289 175.9682 74 I 4.8397 8.2486 125.3566 59.9996 38.4940 176.2250 75 V 4.0676 8.0238 124.9342 61.1330 30.7748 174.4694 76 D 4.7342 8.2632 122.5243 52.7270 39.8020 173.1855 77 Y 4.4439 8.1400 122.4661 55.1160 41.5209 174.9587 78 S 4.6807 7.2845 121.0097 55.6993 64.5389 172.2400 79 P 3.8309 0.0000 0.0000 65.4787 30.3537 177.1087 80 Q 3.4905 6.5325 115.5524 60.3236 29.3472 177.8082 81 Q 4.2851 8.6154 127.3280 54.9787 27.6613 174.7192 82 E 4.4837 8.4936 123.6332 53.9412 32.9884 174.2940 83 G 4.3859 9.1524 111.5077 45.6050 0.0000 173.8031 84 K 4.1129 7.4770 120.1426 54.4367 33.2301 176.6761 85 V 3.6307 8.5561 125.6598 66.5219 31.4094 179.9542 86 F 3.1755 5.7078 107.5535 55.8302 41.1029 175.2269 87 F 4.9093 7.9313 121.5937 56.0989 42.9115 174.2945 88 G 3.2776 6.4331 110.4529 46.0201 0.0000 172.8476 89 A 3.9683 7.0528 120.5566 49.0784 21.3937 176.9798 90 W 4.3108 8.9057 123.9599 56.7951 30.1027 175.8341 91 V 4.7880 8.4273 125.4825 60.9139 34.1342 174.0116 92 E 4.7685 8.3058 124.8473 54.4613 32.5248 175.0996 93 I 5.3861 8.0378 114.8381 59.2193 41.7152 173.7307 94 E 5.1652 9.3814 120.5855 54.7559 32.5956 174.1802 95 N 5.1312 8.5509 117.9920 51.8307 42.2080 174.8519 96 D 4.4039 8.8608 123.6893 57.7399 41.4125 177.2626 97 D 4.5159 8.0104 115.0543 54.9981 41.1529 176.4522 98 G 4.1364 8.3789 109.0079 45.9752 0.0000 174.4291 99 V 4.2252 7.8395 119.9452 61.2402 32.5354 173.8642 100 T 5.2205 8.4798 121.8565 59.6569 68.0549 172.5448 101 H 4.9228 8.6252 127.9686 54.8105 33.5428 173.0479 102 R 4.8306 8.8341 122.4830 54.2674 31.3755 175.4262 103 F 4.9534 7.2780 117.0199 56.7570 39.5206 172.5337 104 R 4.8117 7.8653 121.2967 53.5399 32.6082 174.8472 105 I 4.2851 7.7514 126.1785 60.7683 38.5842 175.2628 106 V 4.7211 8.6731 119.6101 59.3319 36.5850 175.1657 107 G 4.0536 8.7737 110.8678 45.6238 0.0000 173.4551 108 Y 4.1146 8.7111 121.9723 60.4450 38.9944 176.8837 109 D 4.1945 8.1577 118.1299 57.0458 40.9511 177.5921 110 E 3.9639 7.6096 123.7600 53.9032 30.5260 174.4152 111 I 4.1661 6.6090 121.4331 58.7711 41.3392 174.2352 112 F 4.8233 8.2179 123.9590 56.1000 43.0257 175.2831 113 G 3.4881 8.6705 106.8026 46.7079 0.0000 175.0784 114 R 4.1173 7.8683 117.0027 58.1811 30.2675 178.1611 115 K 4.3610 8.0964 118.6776 57.3283 32.8790 177.1763 116 D 4.5842 7.8010 116.1188 53.4050 44.8144 175.5622 117 Y 4.8562 8.8223 124.0551 56.7344 38.6233 175.7409 118 I 4.5656 7.3810 120.0700 60.5365 41.1573 175.8158 119 S 5.7627 8.8307 121.4952 56.6333 64.3708 174.3914 120 I 3.8636 8.4361 115.6262 63.7428 38.6752 177.5019 121 D 4.8532 7.5044 118.6045 54.2716 40.4304 175.9974 122 S 4.7630 8.2179 113.7020 55.6282 65.3772 172.5007 123 P 4.1360 0.0000 0.0000 66.6101 30.9970 178.2941 124 M 3.8609 7.9283 115.5668 58.8685 31.8554 178.1711 125 A 3.9917 7.5699 119.3966 54.8783 18.6865 179.7592 126 R 3.9885 8.2286 117.0029 59.3219 30.0512 178.8009 127 A 3.9746 7.8824 119.2011 55.3120 18.6387 179.2205 128 L 4.1351 8.1407 116.0752 57.5277 42.0143 177.4691 129 L 3.4238 7.4713 116.5875 58.0343 42.8545 176.0293 130 K 4.4541 7.6231 124.8967 53.9315 32.7033 174.8778 131 K 4.5311 7.7285 119.8768 53.7919 36.4623 176.1116 132 E 4.0466 8.8724 123.4522 56.1203 29.8914 177.8787 133 V 3.8172 8.2716 114.1102 63.8049 31.9831 177.4287 134 G 4.4047 7.6888 106.6901 44.3222 0.0000 172.6474 135 D 5.0096 8.2088 119.4926 53.1337 44.2169 177.4311 136 L 4.8332 8.5193 120.0452 53.5014 41.9033 175.9597 137 A 4.5791 9.0915 126.8115 50.8532 20.6227 176.0674 138 V 4.9400 8.3010 119.8383 61.3843 34.7994 175.3170 139 V 4.7462 8.8603 118.6619 59.8787 36.0784 173.7504 140 N 5.6413 8.5311 121.5056 51.7921 40.6361 173.1557 141 T 4.3399 9.4731 113.5875 61.3361 70.7625 172.3833 142 P 3.4162 0.0000 0.0000 64.0872 32.0616 176.2448 143 A 4.2337 8.2007 128.2939 52.7359 20.3163 178.1613 144 G 3.8225 7.8511 106.4990 44.5469 0.0000 172.4139 145 E 5.0174 8.4684 124.1180 53.9914 31.6236 175.3918 146 A 4.5308 8.8179 124.5784 50.4002 23.2512 174.7809 147 S 4.9867 7.9982 115.2553 56.3017 65.4342 173.4536 148 W 5.3871 9.5495 122.6617 55.2211 34.1430 173.3737 149 Y 5.4359 8.6911 119.7785 56.1228 40.0841 175.4204 150 V 3.6343 8.8871 125.3894 63.7748 32.0745 174.5165 151 N 4.8825 9.4846 127.1621 53.5857 38.2274 174.5581 152 A 4.7494 7.6870 119.1083 50.3053 23.6627 174.2658 153 I 4.7758 8.4741 121.2190 59.4403 39.8835 174.5618 154 E 4.7723 9.2064 129.3659 54.9099 32.5114 174.6912 155 Y 4.8663 8.9990 123.3550 56.3936 39.4790 176.4626 156 V 4.0892 8.3244 123.3055 62.0280 31.3720 174.4487 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 M 8.30 4.34 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.59 0.00 2 K 7.95 4.24 0.00 1.78 1.75 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.27 1.48 7.81 3 T 9.08 4.64 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 4 P 0.00 4.48 0.00 2.07 2.23 0.00 3.61 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.11 0.00 5 L 7.90 4.55 0.00 1.51 1.38 0.76 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 6 V 9.18 4.84 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 1.04 0.00 0.00 7 T 8.76 4.63 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 8 R 8.87 4.01 0.00 1.96 2.05 0.00 3.40 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 9 E 8.43 4.25 0.00 2.32 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.51 0.00 10 G 8.08 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 Y 8.03 3.76 0.00 3.43 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.16 4.07 0.00 2.15 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.77 0.00 13 K 7.84 3.95 0.00 2.10 1.81 0.00 1.37 0.00 0.00 1.39 0.00 0.00 2.37 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.35 1.63 7.81 14 L 7.80 3.97 0.00 1.78 1.68 0.58 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.24 3.99 0.00 2.04 1.92 0.00 1.82 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.59 1.91 7.81 16 Q 8.33 4.03 0.00 2.22 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.79 0.00 0.00 0.00 0.00 0.00 2.43 2.51 0.00 17 E 8.89 3.97 0.00 2.21 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.48 0.00 18 L 7.95 3.72 0.00 1.79 1.89 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 19 N 8.20 4.45 0.00 3.11 2.94 0.00 0.00 6.54 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 8.65 4.01 0.00 3.21 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 L 9.04 4.13 0.00 2.05 1.84 0.98 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 22 W 8.26 4.33 0.00 3.27 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 R 8.25 4.10 0.00 2.13 1.87 0.00 3.31 0.00 0.00 3.21 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.31 0.00 24 E 7.90 4.31 0.00 1.57 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 2.20 0.00 25 E 8.54 4.56 0.00 2.20 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.58 0.00 26 R 8.20 3.89 0.00 2.11 1.88 0.00 3.19 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.73 0.00 27 P 0.00 4.20 0.00 2.14 2.01 0.00 3.71 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.03 0.00 28 E 7.55 3.95 0.00 2.44 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 29 V 8.10 3.65 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.97 0.00 0.00 30 T 8.05 3.90 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 31 K 7.99 3.99 0.00 2.11 2.06 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.56 1.53 7.81 32 K 7.93 4.07 0.00 1.95 1.87 0.00 1.68 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.80 1.60 7.81 33 V 7.69 3.79 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.87 0.00 0.00 34 T 7.85 3.91 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 35 W 8.52 4.06 0.00 3.74 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 A 8.71 4.15 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 7.63 3.70 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 S 7.71 4.05 0.00 3.67 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 L 8.72 4.37 0.00 2.00 1.88 1.05 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 40 G 7.42 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 D 8.04 4.38 0.00 2.90 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 R 8.53 3.72 0.00 1.80 1.99 0.00 3.20 0.00 0.00 3.12 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.49 0.00 43 S 8.13 4.32 0.00 3.86 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.20 4.00 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.43 0.00 45 N 7.91 4.52 0.00 3.00 2.89 0.00 0.00 6.98 8.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 A 8.63 4.10 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 8.56 4.53 0.00 2.98 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 Y 8.35 4.20 0.00 3.12 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 Q 7.84 3.71 0.00 2.27 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.56 0.00 0.00 0.00 0.00 0.00 2.71 2.60 0.00 50 Y 8.37 4.05 0.00 3.08 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 N 8.30 4.24 0.00 2.82 2.86 0.00 0.00 6.72 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 7.49 3.78 0.00 1.40 1.70 0.00 1.42 0.00 0.00 1.43 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.21 1.33 7.81 53 K 7.77 3.77 0.00 1.76 1.74 0.00 1.67 0.00 0.00 1.51 0.00 0.00 3.17 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.55 1.36 7.81 54 R 7.54 3.97 0.00 1.41 1.63 0.00 3.13 0.00 0.00 3.04 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.46 0.00 55 L 7.69 4.14 0.00 1.79 1.75 0.95 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 56 R 7.91 3.92 0.00 2.01 1.92 0.00 3.14 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 57 E 8.96 3.95 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.51 0.00 58 I 8.04 3.68 1.99 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.86 0.95 0.00 0.00 59 D 8.29 4.53 0.00 2.80 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 R 7.63 3.91 0.00 2.01 1.97 0.00 3.18 0.00 0.00 3.07 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.83 0.00 61 R 8.02 3.96 0.00 1.87 1.94 0.00 3.08 0.00 0.00 3.10 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 62 V 7.84 3.65 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.09 0.00 0.00 63 R 7.86 3.86 0.00 2.10 2.25 0.00 3.18 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 64 Y 8.04 3.98 0.00 3.05 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 L 8.68 3.97 0.00 2.10 1.70 1.01 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 66 T 7.74 3.86 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 67 K 7.79 3.78 0.00 1.86 1.99 0.00 1.15 0.00 0.00 1.55 0.00 0.00 2.28 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.49 1.24 7.81 68 C 8.10 4.05 0.00 2.83 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 M 7.83 3.95 0.00 2.06 2.24 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.72 0.00 70 E 7.59 4.17 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 71 N 7.85 4.70 0.00 2.68 2.84 0.00 0.00 7.07 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 L 7.70 4.29 0.00 1.69 1.85 0.99 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 73 K 9.17 4.56 0.00 1.60 1.69 0.00 1.66 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.53 7.81 74 I 8.25 4.84 1.80 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.45 0.94 0.00 0.00 75 V 8.02 4.07 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 0.12 0.00 0.00 76 D 8.26 4.73 0.00 2.69 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 Y 8.14 4.44 0.00 3.04 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 S 7.28 4.68 0.00 3.81 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 P 0.00 3.83 0.00 2.06 2.30 0.00 3.75 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.38 0.00 80 Q 6.53 3.49 0.00 1.82 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.21 0.00 0.00 0.00 0.00 0.00 2.46 2.51 0.00 81 Q 8.62 4.29 0.00 2.26 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.39 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 82 E 8.49 4.48 0.00 2.12 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.07 0.00 83 G 9.15 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 K 7.48 4.11 0.00 1.66 1.41 0.00 1.71 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.30 0.99 7.81 85 V 8.56 3.63 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.97 0.00 0.00 86 F 5.71 3.18 0.00 3.32 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 F 7.93 4.91 0.00 3.06 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 G 6.43 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 A 7.05 3.97 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 W 8.91 4.31 0.00 3.42 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 V 8.43 4.79 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.87 0.00 0.00 92 E 8.31 4.77 0.00 1.90 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.16 0.00 93 I 8.04 5.39 1.93 0.00 0.00 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.78 0.92 0.00 0.00 94 E 9.38 5.17 0.00 2.24 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.64 0.00 95 N 8.55 5.13 0.00 2.91 3.05 0.00 0.00 7.09 8.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 D 8.86 4.40 0.00 2.65 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 D 8.01 4.52 0.00 2.78 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 G 8.38 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 V 7.84 4.23 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 1.04 0.00 0.00 100 T 8.48 5.22 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 101 H 8.63 4.92 0.00 3.25 3.09 0.00 5.71 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 R 8.83 4.83 0.00 1.95 1.96 0.00 2.98 0.00 0.00 2.25 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.57 0.00 103 F 7.28 4.95 0.00 3.02 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 R 7.87 4.81 0.00 0.67 0.91 0.00 2.21 0.00 0.00 2.96 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.50 0.00 105 I 7.75 4.29 1.75 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.84 0.91 0.00 0.00 106 V 8.67 4.72 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.93 0.00 0.00 107 G 8.77 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 Y 8.71 4.11 0.00 2.89 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 D 8.16 4.19 0.00 2.70 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 E 7.61 3.96 0.00 1.87 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.47 0.00 111 I 6.61 4.17 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.08 0.73 0.00 0.00 112 F 8.22 4.82 0.00 3.07 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 G 8.67 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 R 7.87 4.12 0.00 1.91 1.97 0.00 2.91 0.00 0.00 2.71 7.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.72 0.00 115 K 8.10 4.36 0.00 1.90 1.98 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.14 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.57 1.79 7.81 116 D 7.80 4.58 0.00 2.42 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 Y 8.82 4.86 0.00 2.98 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 I 7.38 4.57 1.92 0.00 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.47 0.71 0.00 0.00 119 S 8.83 5.76 0.00 4.02 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 I 8.44 3.86 1.94 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.98 1.06 0.00 0.00 121 D 7.50 4.85 0.00 2.63 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 S 8.22 4.76 0.00 3.80 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 P 0.00 4.14 0.00 2.12 2.14 0.00 3.54 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 124 M 7.93 3.86 0.00 1.70 1.73 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.02 0.00 125 A 7.57 3.99 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.23 3.99 0.00 1.99 1.98 0.00 3.30 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.77 0.00 127 A 7.88 3.97 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 L 8.14 4.14 0.00 1.80 1.82 1.05 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 129 L 7.47 3.42 0.00 2.04 1.52 1.05 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 130 K 7.62 4.45 0.00 1.70 1.61 0.00 1.71 0.00 0.00 1.79 0.00 0.00 3.44 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.46 7.81 131 K 7.73 4.53 0.00 1.68 1.77 0.00 1.89 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.34 1.40 7.81 132 E 8.87 4.05 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 133 V 8.27 3.82 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.94 0.00 0.00 134 G 7.69 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 D 8.21 5.01 0.00 2.68 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 L 8.52 4.83 0.00 1.44 1.33 1.04 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 137 A 9.09 4.58 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 V 8.30 4.94 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.90 0.00 0.00 139 V 8.86 4.75 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.12 0.00 0.00 140 N 8.53 5.64 0.00 2.64 2.73 0.00 0.00 5.92 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 T 9.47 4.34 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 142 P 0.00 3.42 0.00 2.09 1.83 0.00 3.71 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.13 0.00 143 A 8.20 4.23 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 G 7.85 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 E 8.47 5.02 0.00 1.90 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 146 A 8.82 4.53 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 S 8.00 4.99 0.00 3.59 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 W 9.55 5.39 0.00 3.39 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 Y 8.69 5.44 0.00 3.00 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 V 8.89 3.63 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.02 0.00 0.00 151 N 9.48 4.88 0.00 2.72 2.69 0.00 0.00 6.78 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 A 7.69 4.75 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 I 8.47 4.78 1.94 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.18 1.03 0.00 0.00 154 E 9.21 4.77 0.00 2.02 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.32 0.00 155 Y 9.00 4.87 0.00 2.83 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 V 8.32 4.09 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.93 0.00 0.00